Chembase list of 866358 unique molecular structures

ID: 811951

ethyl 6-fluoro-1,2,3,4-tetrahydroisoquinoline-1-carboxylate

$$$$

M. F.

C12H14FNO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31605

Database

Data ID

M. W.

223.2434632

CAS

1260640-16-1

Similarity

N/A

ID: 811952

ethyl 6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate

$$$$

M. F.

C13H17NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31606

Database

Data ID

M. W.

235.27898

CAS

Similarity

N/A

ID: 811953

6-chloro-1,2,3,4-tetrahydroisoquinoline-1-carboxylic acid

$$$$

M. F.

C10H10ClNO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31609

Database

Data ID

M. W.

211.6449

CAS

1260644-33-4

Similarity

N/A

ID: 811954

2-[(tert-butoxy)carbonyl]-6-hydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylic ...

$$$$

M. F.

C15H19NO5

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31611

Database

Data ID

M. W.

293.31506

CAS

362492-00-0

Similarity

N/A

ID: 811955

2-[(tert-butoxy)carbonyl]-6-methoxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylic ...

$$$$

M. F.

C16H21NO5

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31612

Database

Data ID

M. W.

307.34164

CAS

499139-27-4

Similarity

N/A

ID: 811956

2-[(tert-butoxy)carbonyl]-6-chloro-1,2,3,4-tetrahydroisoquinoline-1-carboxylic a...

$$$$

M. F.

C15H18ClNO4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31614

Database

Data ID

M. W.

311.76072

CAS

871730-33-5

Similarity

N/A

ID: 811957

1,2,3,4-tetrahydroisoquinolin-6-amine

$$$$

M. F.

C9H12N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31617

Database

Data ID

M. W.

148.20498

CAS

72299-67-3

Similarity

N/A

ID: 811958

6-fluoro-1,2,3,4-tetrahydroisoquinolin-1-one

$$$$

M. F.

C9H8FNO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31621

Database

Data ID

M. W.

165.1643232

CAS

214045-84-8

Similarity

N/A

ID: 811959

7-methyl-1,2,3,4-tetrahydroisoquinolin-1-one

$$$$

M. F.

C10H11NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31624

Database

Data ID

M. W.

161.20044

CAS

371756-25-1

Similarity

N/A

ID: 811960

6,7-dihydroxy-1,2,3,4-tetrahydroisoquinolin-1-one

$$$$

M. F.

C9H9NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31625

Database

Data ID

M. W.

179.17266

CAS

330847-76-2

Similarity

N/A

ID: 811961

7-chloro-1,2,3,4-tetrahydroisoquinolin-1-one

$$$$

M. F.

C9H8ClNO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31626

Database

Data ID

M. W.

181.61892

CAS

22245-95-0

Similarity

N/A

ID: 811962

7-hydroxy-1,2,3,4-tetrahydroisoquinolin-1-one

$$$$

M. F.

C9H9NO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31628

Database

Data ID

M. W.

163.17326

CAS

22246-05-5

Similarity

N/A

ID: 811963

ethyl N-(1-oxo-1,2,3,4-tetrahydroisoquinolin-7-yl)carbamate

$$$$

M. F.

C12H14N2O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31629

Database

Data ID

M. W.

234.25116

CAS

885273-79-0

Similarity

N/A

ID: 811964

4-methyl-1,2,3,4-tetrahydroisoquinolin-1-one

$$$$

M. F.

C10H11NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31630

Database

Data ID

M. W.

161.20044

CAS

70079-42-4

Similarity

N/A

ID: 811965

5-chloro-1,2,3,4-tetrahydroisoquinolin-1-one

$$$$

M. F.

C9H8ClNO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31631

Database

Data ID

M. W.

181.61892

CAS

129075-59-8

Similarity

N/A

ID: 811966

5,7-dichloro-1,2,3,4-tetrahydroisoquinolin-1-one

$$$$

M. F.

C9H7Cl2NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31632

Database

Data ID

M. W.

216.06398

CAS

885273-81-4

Similarity

N/A

ID: 811967

tert-butyl N-[(1,2,3,4-tetrahydroisoquinolin-3-yl)methyl]carbamate

$$$$

M. F.

C15H22N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31635

Database

Data ID

M. W.

262.34738

CAS

885273-85-8

Similarity

N/A

ID: 811968

(2-benzyl-1,2,3,4-tetrahydroisoquinolin-3-yl)methanamine

$$$$

M. F.

C17H20N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31636

Database

Data ID

M. W.

252.3541

CAS

Similarity

N/A

ID: 811969

2-benzyl-1,2,3,4-tetrahydroisoquinoline-3-carboxamide

$$$$

M. F.

C17H18N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31637

Database

Data ID

M. W.

266.33762

CAS

54329-49-6

Similarity

N/A

ID: 811970

benzyl (3S)-3-(aminomethyl)-1,2,3,4-tetrahydroisoquinoline-2-carboxylate

$$$$

M. F.

C18H20N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31638

Database

Data ID

M. W.

296.3636

CAS

Similarity

N/A

ID: 811971

(9H-fluoren-9-yl)methyl (3S)-3-(aminomethyl)-1,2,3,4-tetrahydroisoquinoline-2-ca...

$$$$

M. F.

C25H25ClN2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31639

Database

Data ID

M. W.

420.9312

CAS

Similarity

N/A

ID: 811972

benzyl 2-(morpholin-3-yl)acetate

$$$$

M. F.

C13H17NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31640

Database

Data ID

M. W.

235.27898

CAS

885273-91-6

Similarity

N/A

ID: 811973

methyl 2-(morpholin-2-yl)acetate

$$$$

M. F.

C7H13NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31642

Database

Data ID

M. W.

159.18302

CAS

473269-88-4

Similarity

N/A

ID: 811974

ethyl 2-(morpholin-2-yl)acetate

$$$$

M. F.

C8H15NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31643

Database

Data ID

M. W.

173.2096

CAS

503601-25-0

Similarity

N/A

ID: 811975

methyl 3-(morpholin-3-yl)propanoate

$$$$

M. F.

C8H15NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31646

Database

Data ID

M. W.

173.2096

CAS

885273-99-4

Similarity

N/A

ID: 811976

ethyl 3-(morpholin-3-yl)propanoate

$$$$

M. F.

C9H17NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31647

Database

Data ID

M. W.

187.23618

CAS

885274-01-1

Similarity

N/A

ID: 811977

tert-butyl 3-(morpholin-3-yl)propanoate

$$$$

M. F.

C11H21NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31648

Database

Data ID

M. W.

215.28934

CAS

885274-03-3

Similarity

N/A

ID: 811978

3-{4-[(tert-butoxy)carbonyl]morpholin-3-yl}propanoic acid

$$$$

M. F.

C12H21NO5

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31649

Database

Data ID

M. W.

259.29884

CAS

885274-05-5

Similarity

N/A

ID: 811979

3-(4-{[(9H-fluoren-9-yl)methoxy]carbonyl}morpholin-3-yl)propanoic acid

$$$$

M. F.

C22H23NO5

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31650

Database

Data ID

M. W.

381.42172

CAS

885274-10-2

Similarity

N/A

ID: 811980

(3R)-4-[(tert-butoxy)carbonyl]thiomorpholine-3-carboxylic acid

$$$$

M. F.

C10H17NO4S

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31651

Database

Data ID

M. W.

247.31128

CAS

114525-81-4

Similarity

N/A

ID: 811981

(3S)-4-[(tert-butoxy)carbonyl]thiomorpholine-3-carboxylic acid

$$$$

M. F.

C10H17NO4S

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31652

Database

Data ID

M. W.

247.31128

CAS

128453-98-5

Similarity

N/A

ID: 811982

(3S)-thiomorpholine-3-carboxylic acid

$$$$

M. F.

C5H9NO2S

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31653

Database

Data ID

M. W.

147.19546

CAS

73401-53-3

Similarity

N/A

ID: 811983

tert-butyl N-(4-hydroxynaphthalen-1-yl)carbamate

$$$$

M. F.

C15H17NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31654

Database

Data ID

M. W.

259.30038

CAS

285984-22-7

Similarity

N/A

ID: 811984

6-methoxy-1,2,3,4-tetrahydronaphthalen-2-ol

$$$$

M. F.

C11H14O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31655

Database

Data ID

M. W.

178.22766

CAS

1447-87-6

Similarity

N/A

ID: 811985

2-(6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)acetic acid

$$$$

M. F.

C13H16O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31656

Database

Data ID

M. W.

220.26434

CAS

100612-67-7

Similarity

N/A

ID: 811986

6-methoxy-1,2,3,4-tetrahydronaphthalen-2-amine

$$$$

M. F.

C11H15NO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31657

Database

Data ID

M. W.

177.2429

CAS

81861-30-5

Similarity

N/A

ID: 811987

6-fluoro-1,2,3,4-tetrahydronaphthalen-2-ol

$$$$

M. F.

C10H11FO

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31658

Database

Data ID

M. W.

166.1921432

CAS

85072-31-7

Similarity

N/A

ID: 811988

2-{[(tert-butoxy)carbonyl]amino}-6-fluoro-1,2,3,4-tetrahydronaphthalene-2-carbox...

$$$$

M. F.

C16H20FNO4

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31659

Database

Data ID

M. W.

309.3327032

CAS

885274-13-5

Similarity

N/A

ID: 811989

2-amino-6-methoxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid

$$$$

M. F.

C12H15NO3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31660

Database

Data ID

M. W.

221.2524

CAS

35581-10-3

Similarity

N/A

ID: 811990

6-methoxy-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid

$$$$

M. F.

C12H14O3

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31661

Database

Data ID

M. W.

206.23776

CAS

2471-69-4

Similarity

N/A

ID: 811991

2-{[(tert-butoxy)carbonyl]amino}-6-methoxy-1,2,3,4-tetrahydronaphthalene-2-carbo...

$$$$

M. F.

C17H23NO5

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31662

Database

Data ID

M. W.

321.36822

CAS

885274-19-1

Similarity

N/A

ID: 811992

2-amino-6-fluoro-1,2,3,4-tetrahydronaphthalene-2-carboxylic acid

$$$$

M. F.

C11H12FNO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31663

Database

Data ID

M. W.

209.2168832

CAS

885274-22-6

Similarity

N/A

ID: 811993

(1,3-oxazol-2-yl)methanamine

$$$$

M. F.

C4H6N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31664

Database

Data ID

M. W.

98.10324

CAS

885331-17-9

Similarity

N/A

ID: 811994

1,3-oxazole-2-carbohydrazide

$$$$

M. F.

C4H5N3O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31665

Database

Data ID

M. W.

127.1014

CAS

90831-48-4

Similarity

N/A

ID: 811995

1,3-oxazole-2-carbothioamide

$$$$

M. F.

C4H4N2OS

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31666

Database

Data ID

M. W.

128.15236

CAS

885274-25-9

Similarity

N/A

ID: 811996

1,3-oxazole-2-carboxamide

$$$$

M. F.

C4H4N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31667

Database

Data ID

M. W.

112.08676

CAS

884539-45-1

Similarity

N/A

ID: 811997

1,3-oxazole-5-carboxamide

$$$$

M. F.

C4H4N2O2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31671

Database

Data ID

M. W.

112.08676

CAS

158178-93-9

Similarity

N/A

ID: 811998

1,3-oxazole-5-carbonitrile

$$$$

M. F.

C4H2N2O

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31673

Database

Data ID

M. W.

94.07148

CAS

68776-61-4

Similarity

N/A

ID: 811999

2-(1,2-oxazol-3-yl)phenol

$$$$

M. F.

C9H7NO2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31675

Database

Data ID

M. W.

161.15738

CAS

61348-48-9

Similarity

N/A

ID: 812000

1-[(cyclohex-3-en-1-yl)methyl]piperidin-4-amine

$$$$

M. F.

C12H22N2

Suppliers	Catalog Number
A&J Pharmtech	AJA-O31677

Database

Data ID

M. W.

194.31648

CAS

64730-01-4

Similarity

N/A

Part I: Carbon
- I.1: Carbon-Carbon Bonds
- I.1.1 Alkanes
- Primary carbon
- Secondary carbon
- Tertiary carbon
- Quaternary carbon
- I.1.2 C-C double and Triple Bonds
- Alkene
- Alkyne
- Allene
- I.2: One Carbon-Hetero Bond
- I.2.1 Alkyl Halogenides
- Alkylchloride
- Alkylfluoride
- Alkylbromide
- Alkyliodide
- I.2.2 Alcohols and Ethers
- Alcohol
- Primary alcohol
- Secondary alcohol
- Tertiary alcohol
- Dialkylether
- Dialkylthioether
- Alkylarylether
- Diarylether
- Alkylarylthioether
- Diarylthioether
- Oxonium
- I.2.3 Amines
- Amine
- Primary aliphatic amine
- Secondary aliphatic amine
- Tertiary aliphatic amine
- Quaternary aliphatic ammonium
- Primary aromatic amine
- Secondary aromatic amine
- Tertiary aromatic amine
- Quaternary aromatic ammonium
- Secondary mixed amine
- Tertiary mixed amine
- Quaternary mixed ammonium
- Ammonium
- I.2.4 Others
- Alkylthiol
- Dialkylthioether
- Alkylarylthioether
- Disulfide
- 1,2-Aminoalcohol
- 1,2-Diol
- 1,1-Diol
- Hydroperoxide
- Peroxo
- Organolithium compounds
- Organomagnesium compounds
- Organometallic compounds
- I.3: Two Carbon-Hetero Bonds (Carbonyl and Derivatives)
- I.3.1 Double Bond to Hetero
- Aldehyde
- Ketone
- Thioaldehyde
- Thioketone
- Imine
- Immonium
- Oxime
- Oximether
- I.3.2. Two Single Bonds to Hetero
- Acetal
- Hemiacetal
- Aminal
- Hemiaminal
- Thioacetal
- Thiohemiacetal
- Halogen acetal like
- Acetal like
- Halogenmethylen ester and similar
- NOS methylen ester and similar
- Hetero methylen ester and similar
- Cyanhydrine
- I.3.3 Single Bond to Hetero, C=C Double Bond (Enols and Similar)
- Chloroalkene
- Fluoroalkene
- Bromoalkene
- Iodoalkene
- Enol
- Endiol
- Enolether
- Enolester
- Enamine
- Thioenol
- Thioenolether
- I.4: Three Carbon-Hetero Bonds (Carboxyl and Derivatives)
- Acylchloride
- Acylfluoride
- Acylbromide
- Acyliodide
- Acylhalide
- Carboxylic acid
- Carboxylic ester
- Lactone
- Carboxylic anhydride
- Carboxylic acid derivative
- Carbothioic acid
- Carbothioic S ester
- Carbothioic S lactone
- Carbothioic O ester
- Carbothioic O lactone
- Carbothioic halide
- Carbodithioic acid
- Carbodithioic ester
- Carbodithiolactone
- Amide
- Primary amide
- Secondary amide
- Tertiary amide
- Lactam
- Alkyl imide
- N hetero imide
- Imide acidic
- Thioamide
- Thiolactam
- Oximester
- Amidine
- Hydroxamic acid
- Hydroxamic acid ester
- Imidoacid
- Imidoacid cyclic
- Imidoester
- Imidolactone
- Imidothioacid
- Imidothioacid cyclic
- Imidothioester
- Imidothiolactone
- Amidine
- Imidolactam
- Imidoylhalide
- Imidoylhalide cyclic
- Amidrazone
- Alpha aminoacid
- Alpha hydroxyacid
- Peptide middle
- Peptide C term
- Peptide N term
- Carboxylic orthoester
- Ketene
- Ketenacetal
- Nitrile
- Isonitrile
- Vinylogous carbonyl or carboxyl derivative
- Vinylogous acid
- Vinylogous ester
- Vinylogous amide
- Vinylogous halide
- I.5: Four Carbon-Hetero Bonds (Carbonic Acid and Derivatives)
- Carbonic acid dieester
- Carbonic acid esterhalide
- Carbonic acid monoester
- Carbonic acid derivatives
- Thiocarbonic acid dieester
- Thiocarbonic acid esterhalide
- Thiocarbonic acid monoester
- Urea
- Thiourea
- Isourea
- Isothiourea
- Guanidine
- Carbaminic acid
- Urethan(Carbamate ester)
- Biuret
- Semicarbazide
- Carbazide
- Semicarbazone
- Carbazone
- Thiosemicarbazide
- Thiocarbazide
- Thiosemicarbazone
- Thiocarbazone
- Isocyanate
- Cyanate
- Isothiocyanate
- Thiocyanate
- Carbodiimide
- Orthocarbonic derivatives
- I.6 Aromatics
- Phenol
- 1,2-Diphenol
- Arylchloride
- Arylfluoride
- Arylbromide
- Aryliodide
- Arylthiol
- Iminoarene
- Oxoarene
- Thioarene
- Hetero N basic H
- Hetero N basic no H
- Hetero N nonbasic
- Hetero O
- Hetero S
- Heteroaromatic
Part II: N, S, P, Si, B
- II.1 Nitrogen
- Nitrite
- Thionitrite
- Nitrate
- Nitro
- Nitroso
- Azide
- Acylazide
- Diazo
- Diazonium
- Nitrosamine
- Nitrosamide
- N-Oxide
- Hydrazine
- Hydrazone
- Hydroxylamine
- II.2 Sulfur
- Sulfon
- Sulfoxide
- Sulfonium
- Sulfuric acid
- Sulfuric monoester
- Sulfuric diester
- Sulfuric monoamide
- Sulfuric diamide
- Sulfuric esteramide
- Sulfuric derivative
- Sulfonic acid
- Sulfonamide
- Sulfonic ester
- Sulfonic halide
- Sulfonic derivative
- Sulfinic acid
- Sulfinic amide
- Sulfinic ester
- Sulfinic halide
- Sulfinic derivative
- Sulfenic acid
- Sulfenic amide
- Sulfenic ester
- Sulfenic halide
- Sulfenic derivative
- II.3 Phosphorous
- Phosphine
- Phosphine oxide
- Phosphonium
- Phosphorylen
- Phosphonic acid
- Phosphonic monoester
- Phosphonic diester
- Phosphonic monoamide
- Phosphonic diamide
- Phosphonic esteramide
- Phosphonic acid derivative
- Phosphoric acid
- Phosphoric monoester
- Phosphoric diester
- Phosphoric triester
- Phosphoric monoamide
- Phosphoric diamide
- Phosphoric triamide
- Phosphoric monoestermonoamide
- Phosphoric diestermonoamide
- Phosphoric monoesterdiamide
- Phosphoric acid derivative
- Phosphinic acid
- Phosphinic ester
- Phosphinic amide
- Phosphinic acid derivative
- Phosphonous acid
- Phosphonous monoester
- Phosphonous diester
- Phosphonous monoamide
- Phosphonous diamide
- Phosphonous esteramide
- Phosphonous derivatives
- Phosphinous acid
- Phosphinous ester
- Phosphinous amide
- Phosphinous derivatives
- II.4 Silicon
- Quart silane
- Non-quart silane
- Silylmonohalide
- Het trialkylsilane
- Dihet dialkylsilane
- Trihet alkylsilane
- Silicic acid derivative
- II.5 Boron
- Trialkylborane
- Boric acid derivatives
- Boronic acid derivative
- Borohydride
- Quaternary boron
Part III: Some Special Patterns
- III.1 Chains
- III.2 Rings
- Aromatic
- Heterocyclic
- Epoxide
- NH aziridine
- Spiro
- Annelated rings
- Bridged rings
- III.3 Sugars and Nucleosides/Nucleotides, Steroids
- Sugar pattern 1
- Sugar pattern 2
- Sugar pattern combi
- Sugar pattern 2 reducing
- Sugar pattern 2 alpha
- Sugar pattern 2 beta
- III.4 Everything else...
- Conjugated double bond
- Conjugated tripple bond
- Cis double bond
- Trans double bond
- Mixed anhydrides
- Halogen on hetero
- Halogen multi subst
- Trifluoromethyl
- C ONS bond
- Charged
- Anion
- Kation
- Salt
- 1,3-Tautomerizable
- 1,5-Tautomerizable
- Rotatable bond
- Michael acceptor
- Dicarbodiazene
- CH-acidic
- CH-acidic strong
- Chiral center specified